General
Preferred name
Ethyl pyruvate
Synonyms
ethyl-pyruvate ()
CTI-01 ()
Pyruvic Acid Ethyl Ester ()
Pyruvic acid, ethyl ester ()
FEMA NO. 2457 ()
NSC-48386 ()
2-Oxo-Propionic Acid Ethyl Ester ()
P&D ID
PD008930
CAS
617-35-6
Tags
drug candidate
natural product
available
Drug Status
investigational
Max Phase
Phase 2
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
7
ChEMBL Drugs
DrugBank
JUMP-Target 1 Compound Set
MedChem Express Bioactive Compound Library
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
116.05
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
0
Rotatable Bonds
2
Ring Count
0
Aromatic Ring Count
0
cLogP
0.14
TPSA
43.37
Fraction CSP3
0.6
Chiral centers
0.0
Largest ring
0.0
QED
0.38
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
oxidation-reduction
Apoptosis
Autophagy
Immunology/Inflammation
NF-κB
Target
antioxidant
TNF
Pyroptosis
Anti-infection,Immunology & Inflammation related
Source data
